SCHEMBL1219703

SCHEMBL1219703

CCCCCNC(CO)CO

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.54
KDM4E B2RXH2 2/20 0.54
CNR1 P21554 2/20 0.54
ADRA1A P35348 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
ABCC3 O15438 1/20 0.52
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.43
EPHX1 P07099 5/20 0.40
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NAAA Q02083 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1222862 0.98 LMNA (0.52) LMNAKDM4ECNR1ADRA1ATDP1
Methyl Alcohol SCHEMBL28137239 0.98 LMNA (0.52) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL1222755 0.98 LMNA (0.52) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL2346969 0.98 LMNA (0.52) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL1223599 0.98 LMNA (0.52) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL7912193 0.92 LMNA (0.56) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL28308123 0.91 LMNA (0.46) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL8975153 0.91 LMNA (0.70) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL16628357 0.89 LMNA (0.67) LMNAKDM4ECNR1ADRA1ATDP1
SCHEMBL9620151 0.89 LMNA (0.67) LMNAKDM4ECNR1ADRA1ATDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110044938-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES NYCOMED GMBH (DE) 2011-02-24 US disclosed
US-20100285149-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES 4SC AG (DE) 2010-11-11 US disclosed
US-7608723-B2 N-(3-aminopropyl)-N-[(1R)-1-(1-benzyl-1H-benzimidazol-2-yl)-2-methylpropyl]-4-chlorobenzamide;kinesin spindle protein modulators; anticarcinogenic agents; in vivo stability, bio-availability; diagnosis/medical/;antitumor agents hyperplasia; restinosis; antiinflammatory agents; cardiac hypertrophy NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2009-10-27 US disclosed
EP-2051974-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES 4SC AG (DE) 2009-04-29 EP disclosed
EP-2051983-A1 NTETRAHYDROPYRIDOTHIOPHENE DERIVATIVES FOR THE TREATMENT OF CANCER 4SC AG (DE) 2009-04-29 EP disclosed
WO-2008020045-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES 4SC AG (DE) 2008-02-21 WO disclosed
WO-2008020024-A1 NTETRAHYDROPYRIDOTHIOPHENE DERIVATIVES FOR THE TREATMENT OF CANCER 4SC AG (DE) 2008-02-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100285149-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES BAX, CCAR2, BCL2 LMNA 3689/4885KDM4E 1608/4885CNR1 2475/4885
US-20110044938-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES BAX, BCL2, BAD LMNA 3666/4885KDM4E 2054/4885CNR1 3905/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.